| SpectraBase Spectrum ID |
95raKYpMktL |
| Name |
2-{[4-Phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(trifluoromethyl)phenyl]acetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
455.102765817 u |
| Formula |
C22H16F3N5OS |
| InChI |
InChI=1S/C22H16F3N5OS/c23-22(24,25)16-8-10-17(11-9-16)27-19(31)14-32-21-29-28-20(15-5-4-12-26-13-15)30(21)18-6-2-1-3-7-18/h1-13H,14H2,(H,27,31) |
| InChIKey |
CWOZMFAUJWUHLO-UHFFFAOYSA-N |
| Molecular Weight |
455.459 g/mol |
| SMILES |
N(C(CSC=1N(C(=NN1)C1=CN=CC=C1)C=1C=CC=CC1)=O)C=1C=CC(C(F)(F)F)=CC1 |
![2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(trifluoromethyl)phenyl]acetamide](/api/spectrum/95raKYpMktL/structure.png?h=300&w=458 "2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(trifluoromethyl)phenyl]acetamide")
